Information card for entry 2021224

Structure parameters

• Chemical name: (<i>E</i>)-[(2-Hydroxyphenylimino)methyl]phenol
• Formula: C13 H11 N O2
• Calculated formula: C13 H11 N O2
• SMILES: c1(c(cccc1)O)NC=c1c(=O)cccc1
• Title of publication: Eight Schiff bases derived from various salicylaldehydes: phenol‒imine and keto‒amine forms, conformational disorder, and supramolecular assembly in one and two dimensions
• Authors of publication: Girisha, Marisiddaiah; Sagar, Belakavadi K.; Yathirajan, Hemmige S.; Rathore, Ravindranath S.; Kaur, Manpreet; Jasinski, Jerry P.; Glidewell, Christopher
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 10
• Pages of publication: 1094 - 1104
• a: 9.0479 ± 0.0007 Å
• b: 10.1564 ± 0.0008 Å
• c: 12.3659 ± 0.001 Å
• α: 69.677 ± 0.006°
• β: 89.94 ± 0.006°
• γ: 77.004 ± 0.006°
• Cell volume: 1034.62 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0614
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.1012
• Weighted residual factors for all reflections included in the refinement: 0.1085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes